Implementation of a quantum mechanics/molecular mechanics approach in the parallel density functional program ParaGauss and applications to model copper thiolate clusters期刊界 All Journals 搜尽天下杂志传播学术成果专业期刊搜索期刊信息化学术搜索

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Implementation of a quantum mechanics/molecular mechanics approach in the parallel density functional program ParaGauss and applications to model copper thiolate clusters

Authors:	T?Kerdcharoen U?Birkenheuer S?Krüger A?Woiterski Email author" target="_blank">N?R?sch Email author

Institution:	(1) Department of Bioengineering, Politecnico di Milano, Via Golgi, 39, 20133 Milano, Italy;(2) Department of Chemical Technology, University of Twente, The Netherlands

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